N-5-Carboxypentyl-1-Deoxynojirimycin
[CAS# 79206-51-2]

Identification

• Name: N-5-Carboxypentyl-1-Deoxynojirimycin
• Synonyms: 6-[(2R,3R,4R,5S)-3,4,5-Trihydroxy-2-(Hydroxymethyl)-1-Piperidyl]Hexanoic Acid; 6-[(2R,3R,4R,5S)-3,4,5-Trihydroxy-2-(Hydroxymethyl)-1-Piperidinyl]Hexanoic Acid; 6-[(2R,3R,4R,5S)-3,4,5-Trihydroxy-2-Methylol-1-Piperidyl]Hexanoic Acid
• Molecular Formula: C₁₂H₂₃NO₆
• Molecular Weight: 277.32
• CAS Registry Number: 79206-51-2
• SMILES: [C@@H]1(CN([C@@H]([C@H]([C@@H]1O)O)CO)CCCCCC(=O)O)O
• InChI: 1S/C12H23NO6/c14-7-8-11(18)12(19)9(15)6-13(8)5-3-1-2-4-10(16)17/h8-9,11-12,14-15,18-19H,1-7H2,(H,16,17)/t8-,9+,11-,12-/m1/s1
• InChIKey: KTNVTDIFZTZBJY-RBLKWDMZSA-N

Properties

• Density: 1.351g/cm³ (Cal.)
• Boiling point: 534.302°C at 760 mmHg (Cal.)
• Flash point: 276.936°C (Cal.)